2-[(4-bromophenyl)sulfonylamino]-N-heptan-2-yl-4-methylsulfanyl-butanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-N-heptan-2-yl-4-methylsulfanyl-butanamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-N-(1-methylhexyl)-4-methylsulfanyl-butanamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-N-heptan-2-yl-4-(methylthio)butanamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-N-heptan-2-yl-4-methylsulfanylbutanamide Traditional Name: 2-(brosylamino)-N-(1-methylhexyl)-4-(methylthio)butyramide Formula: C18H29BrN2O3S2 MolecularWeight: 465.46846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCC(C)NC(=O)C(CCSC)NS(=O)(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C18H29BrN2O3S2/c1-4-5-6-7-14(2)20-18(22)17(12-13-25-3)21-26(23,24)16-10-8-15(19)9-11-16/h8-11,14,17,21H,4-7,12-13H2,1-3H3,(H,20,22)